ethyl 1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate

C17H14N2O2 — CID 11334928

IUPACethyl 1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate
SMILESCCOC(=O)c1cc2ccc3c4ccccc4[nH]c3c2[nH]1
InChIInChI=1S/C17H14N2O2/c1-2-21-17(20)14-9-10-7-8-12-11-5-3-4-6-13(11)18-16(12)15(10)19-14/h3-9,18-19H,2H2,1H3
InChIKeyCKLNENIFGSFRTI-UHFFFAOYSA-N
MW278.31 g/mol
LogP3.98
Rot. Bonds2

About ethyl 1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate

ethyl 1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate (PubChem CID 11334928) has the molecular formula C17H14N2O2 and a molecular weight of 278.31 g/mol. Its IUPAC name is ethyl 1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate.

Molecular Properties

Compound Nameethyl 1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate
PubChem CID11334928
Molecular FormulaC17H14N2O2
Molecular Weight278.31 g/mol
Exact Mass278.11
IUPAC Nameethyl 1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate
SMILESCCOC(=O)c1cc2ccc3c4ccccc4[nH]c3c2[nH]1
InChIInChI=1S/C17H14N2O2/c1-2-21-17(20)14-9-10-7-8-12-11-5-3-4-6-13(11)18-16(12)15(10)19-14/h3-9,18-19H,2H2,1H3
InChIKeyCKLNENIFGSFRTI-UHFFFAOYSA-N
XLogP3.98
TPSA57.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethyl 1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate?
The IUPAC name of ethyl 1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate (CID 11334928) is ethyl 1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate.
What is the SMILES notation for ethyl 1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate?
The canonical SMILES for ethyl 1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate is CCOC(=O)c1cc2ccc3c4ccccc4[nH]c3c2[nH]1.
What is the InChIKey of ethyl 1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate?
The InChIKey is CKLNENIFGSFRTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O2/c1-2-21-17(20)14-9-10-7-8-12-11-5-3-4-6-13(11)18-16(12)15(10)19-14/h3-9,18-19H,2H2,1H3.
What are the key properties of ethyl 1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate?
ethyl 1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate has a molecular weight of 278.31 g/mol, XLogP of 3.98, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate is sourced from PubChem (CID 11334928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).